SCHEMBL8415924

SCHEMBL8415924

C=CCCCC(O)c1cccc(OC)c1CCC(=O)OC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.44
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
PPARA Q07869 3/20 0.38
KDM4E B2RXH2 1/20 0.38
TRPV1 Q8NER1 1/20 0.36
PDE3B Q13370 1/20 0.35
PDE3A Q14432 1/20 0.35
HDAC3 O15379 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC10 Q969S8 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
HDAC9 Q9UKV0 1/20 0.34
HDAC5 Q9UQL6 1/20 0.34
NFE2L2 Q16236 1/20 0.34
AKT1 P31749 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8416461 0.84 PPARG (0.51) PPARGPPARAKDM4EPDE3BPDE3A
SCHEMBL8777227 0.75 PDE3B (0.49) ALDH1A1LMNAKDM4EPDE3BPDE3A
SCHEMBL8686240 0.74 PPARG (0.45) PPARGPPARAKDM4E
SCHEMBL7865492 0.72 RAB9A (0.42) PPARGALDH1A1LMNA
SCHEMBL8416442 0.70 TLR2 (0.51) ALDH1A1LMNAKDM4EPDE3BPDE3A
SCHEMBL27990055 0.69 PDE3B (0.44) ALDH1A1KDM4EPDE3BPDE3A
SCHEMBL8686238 0.69 PPARG (0.49) PPARGPPARAKDM4E
SCHEMBL8413242 0.68 HDAC8 (0.46) KDM4EPDE3BPDE3AHDAC1HDAC8
SCHEMBL8434499 0.67 ALDH1A1 (0.44) ALDH1A1LMNAPPARAKDM4ETRPV1
SCHEMBL11949103 0.67 HTR1A (0.40) PPARGALDH1A1LMNAKDM4ETRPV1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6001877-A OF GIVEN FORMULA, WHICH ACTS AS AN ANTAGONIST OF LEUKOTRIENES; ADMINISTERING TO TREAT LEUKOTRIENE-B4 INDUCED DISEASES, SUCH AS ALLERGIES AND INFLAMMATION ONO PHARMACEUTICAL CO., LTD. (JP) 1999-12-14 US disclosed
US-5795914-A Phenylalkan(en)oic acid ONO PHARMACEUTICAL CO., LTD. (JP) 1998-08-18 US disclosed
EP-0405116-B1 Phenylalkan(en)oic acids ONO PHARMACEUTICAL CO (JP) 1995-12-06 EP disclosed
US-5457122-A Leukotriene antagonists ONO PHARMACEUTICAL CO., LTD. (JP) 1995-10-10 US disclosed
US-5256686-A Antiinflammatory agent, antiallergens ONO PHARMACEUTICAL CO., LTD. (JP) 1993-10-26 US disclosed
US-5155104-A Phenylalkan(en)oic acid ONO PHARMACEUTICAL CO., LTD. (JP) 1992-10-13 US disclosed
US-5086065-A Leukotriene antagonists ONO PHARMACEUTICAL CO., LTD. (JP) 1992-02-04 US disclosed
EP-0405116-A2 Phenylalkan(en)oic acids ONO PHARMACEUTICAL CO., LTD. (JP) 1991-01-02 EP disclosed